BDBM92088 erk000516

SMILES: Cc1cnc(NC2CCCC2)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1ccccc1

InChI Key: InChIKey=TWJZKWNATUQPFH-HXUWFJFHSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 92088   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Mitogen-activated protein kinase 1 (Homo sapiens (Human))	BDBM92088 (erk000516) Show SMILES Cc1cnc(NC2CCCC2)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1ccccc1 Show InChI InChI=1S/C23H27N5O2/c1-15-12-25-23(26-18-9-5-6-10-18)28-21(15)17-11-19(24-13-17)22(30)27-20(14-29)16-7-3-2-4-8-16/h2-4,7-8,11-13,18,20,24,29H,5-6,9-10,14H2,1H3,(H,27,30)(H,25,26,28)/t20-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	D3R	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
D3R					Assay Description Photometric_Method2				D3R 222: (2015) BindingDB Entry DOI: 10.7270/Q2S46QSD
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 1 (Homo sapiens (Human))	BDBM92088 (erk000516) Show SMILES Cc1cnc(NC2CCCC2)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1ccccc1 Show InChI InChI=1S/C23H27N5O2/c1-15-12-25-23(26-18-9-5-6-10-18)28-21(15)17-11-19(24-13-17)22(30)27-20(14-29)16-7-3-2-4-8-16/h2-4,7-8,11-13,18,20,24,29H,5-6,9-10,14H2,1H3,(H,27,30)(H,25,26,28)/t20-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSAR					Assay Description Assay 1 ...				CSAR 1: (2012)
					More data for this Ligand-Target Pair